3-azanyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-(3,3-dimethyl-2-oxo-butyl)-5-thiazol-2-yl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-(2-thiazolyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-(3,3-dimethyl-2-oxobutyl)-5-(1,3-thiazol-2-yl)-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-(2-keto-3,3-dimethyl-butyl)-5-thiazol-2-yl-3H-1,4-benzodiazepin-2-one Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=NC=CS3

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=NC=CS3

InChI

InChI=1S/C18H20N4O2S/c1-18(2,3)13(23)10-22-12-7-5-4-6-11(12)14(16-20-8-9-25-16)21-15(19)17(22)24/h4-9,15H,10,19H2,1-3H3