(2S)-2-azanyl-6-(1-azanylethylideneamino)-N-(2H-1,2,3,4-tetrazol-5-yl)hexanamide; N-[3,5-bis(chloranyl)pyridin-4-yl]-4-[bis(fluoranyl)methoxy]-3-(cyclopropylmethoxy)benzamide; hydrate; dihydrochloride

Systemtic Name: (2S)-2-azanyl-6-(1-azanylethylideneamino)-N-(2H-1,2,3,4-tetrazol-5-yl)hexanamide; N-[3,5-bis(chloranyl)pyridin-4-yl]-4-[bis(fluoranyl)methoxy]-3-(cyclopropylmethoxy)benzamide; hydrate; dihydrochloride Openeye Name: (2S)-2-amino-6-(1-aminoethylideneamino)-N-(2H-tetrazol-5-yl)hexanamide; 3-(cyclopropylmethoxy)-N-(3,5-dichloro-4-pyridyl)-4-(difluoromethoxy)benzamide; hydrate; dihydrochloride CAS Name: (2S)-2-amino-6-(1-aminoethylideneamino)-N-(2H-tetrazol-5-yl)hexanamide; 3-(cyclopropylmethoxy)-N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)benzamide; hydrate; dihydrochloride IUPAC Name: (2S)-2-amino-6-(1-aminoethylideneamino)-N-(2H-tetrazol-5-yl)hexanamide; 3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide; hydrate; dihydrochloride Traditional Name: (2S)-2-amino-6-(1-aminoethylideneamino)-N-(2H-tetrazol-5-yl)hexanamide; 3-(cyclopropylmethoxy)-N-(3,5-dichloro-4-pyridyl)-4-(difluoromethoxy)benzamide; hydrate; dihydrochloride Formula: C26H36Cl4F2N10O5 MolecularWeight: 748.436846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCCC(C(=O)NC1=NNN=N1)N)N.C1CC1COC2=C(C=CC(=C2)C(=O)NC3=C(C=NC=C3Cl)Cl)OC(F)F.O.Cl.Cl

Isomeric SMILES

CC(=NCCCC[C@@H](C(=O)NC1=NNN=N1)N)N.C1CC1COC2=C(C=CC(=C2)C(=O)NC3=C(C=NC=C3Cl)Cl)OC(F)F.O.Cl.Cl

InChI

InChI=1S/C17H14Cl2F2N2O3.C9H18N8O.2ClH.H2O/c18-11-6-22-7-12(19)15(11)23-16(24)10-3-4-13(26-17(20)21)14(5-10)25-8-9-1-2-9;1-6(10)12-5-3-2-4-7(11)8(18)13-9-14-16-17-15-9;;;/h3-7,9,17H,1-2,8H2,(H,22,23,24);7H,2-5,11H2,1H3,(H2,10,12)(H2,13,14,15,16,17,18);2*1H;1H2/t;7-;;;/m.0.../s1