N-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-oxidanylidene-pyrazin-1-yl]ethanamide hydrochloride

Systemtic Name: N-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-oxidanylidene-pyrazin-1-yl]ethanamide hydrochloride Openeye Name: N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-oxo-pyrazin-1-yl]acetamide hydrochloride CAS Name: N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-oxo-1-pyrazinyl]acetamide hydrochloride IUPAC Name: N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-oxopyrazin-1-yl]acetamide hydrochloride Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)benzyl]-2-[3-[3-(cyclopropylmethylamino)propylamino]-2-keto-pyrazin-1-yl]acetamide hydrochloride Formula: C22H28Cl2N8O2 MolecularWeight: 507.41612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNCCCNC2=NC=CN(C2=O)CC(=O)NCC3=C(C=CC(=C3)Cl)N4C=NC=N4.Cl

Isomeric SMILES

C1CC1CNCCCNC2=NC=CN(C2=O)CC(=O)NCC3=C(C=CC(=C3)Cl)N4C=NC=N4.Cl

InChI

InChI=1S/C22H27ClN8O2.ClH/c23-18-4-5-19(31-15-25-14-29-31)17(10-18)12-28-20(32)13-30-9-8-27-21(22(30)33)26-7-1-6-24-11-16-2-3-16;/h4-5,8-10,14-16,24H,1-3,6-7,11-13H2,(H,26,27)(H,28,32);1H