(3S)-3-azanyl-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloranyl-3,4-dihydro-2H-chromen-4-yl]-4-(3,4-dichlorophenyl)sulfonyl-butanamide

Systemtic Name: (3S)-3-azanyl-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloranyl-3,4-dihydro-2H-chromen-4-yl]-4-(3,4-dichlorophenyl)sulfonyl-butanamide Openeye Name: (3S)-3-amino-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloro-chroman-4-yl]-4-(3,4-dichlorophenyl)sulfonyl-butanamide CAS Name: (3S)-3-amino-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloro-3,4-dihydro-2H-1-benzopyran-4-yl]-4-(3,4-dichlorophenyl)sulfonylbutanamide IUPAC Name: (3S)-3-amino-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloro-3,4-dihydro-2H-chromen-4-yl]-4-(3,4-dichlorophenyl)sulfonylbutanamide Traditional Name: (3S)-3-amino-N-[(4R)-7-[(tert-butylamino)methyl]-6-chloro-chroman-4-yl]-4-(3,4-dichlorophenyl)sulfonyl-butyramide Formula: C24H30Cl3N3O4S MolecularWeight: 562.9367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1=C(C=C2C(CCOC2=C1)NC(=O)CC(CS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)N)Cl

Isomeric SMILES

CC(C)(C)NCC1=C(C=C2[C@@H](CCOC2=C1)NC(=O)C[C@@H](CS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)N)Cl

InChI

InChI=1S/C24H30Cl3N3O4S/c1-24(2,3)29-12-14-8-22-17(11-19(14)26)21(6-7-34-22)30-23(31)9-15(28)13-35(32,33)16-4-5-18(25)20(27)10-16/h4-5,8,10-11,15,21,29H,6-7,9,12-13,28H2,1-3H3,(H,30,31)/t15-,21+/m0/s1