N-[1-methyl-2-oxidanylidene-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-3-yl]-2-[(2-oxidanyl-2-phenyl-ethyl)amino]propanamide

Systemtic Name: N-[1-methyl-2-oxidanylidene-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-3-yl]-2-[(2-oxidanyl-2-phenyl-ethyl)amino]propanamide Openeye Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-N-(1-methyl-2-oxo-5-thiazol-2-yl-3H-1,4-benzodiazepin-3-yl)propanamide CAS Name: 2-[(2-hydroxy-2-phenylethyl)amino]-N-[1-methyl-2-oxo-5-(2-thiazolyl)-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: 2-[(2-hydroxy-2-phenylethyl)amino]-N-[1-methyl-2-oxo-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-N-(2-keto-1-methyl-5-thiazol-2-yl-3H-1,4-benzodiazepin-3-yl)propionamide Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=NC=CS3)C)NCC(C4=CC=CC=C4)O

Isomeric SMILES

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=NC=CS3)C)NCC(C4=CC=CC=C4)O

InChI

InChI=1S/C24H25N5O3S/c1-15(26-14-19(30)16-8-4-3-5-9-16)22(31)28-21-24(32)29(2)18-11-7-6-10-17(18)20(27-21)23-25-12-13-33-23/h3-13,15,19,21,26,30H,14H2,1-2H3,(H,28,31)