N-[1-[(1-methyl-2-oxidanylidene-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]butanamide

Systemtic Name: N-[1-[(1-methyl-2-oxidanylidene-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]butanamide Openeye Name: N-[1-methyl-2-[[1-methyl-2-oxo-5-(2-thienyl)-3H-1,4-benzodiazepin-3-yl]amino]-2-oxo-ethyl]butanamide CAS Name: N-[1-[(1-methyl-2-oxo-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]butanamide IUPAC Name: N-[1-[(1-methyl-2-oxo-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]butanamide Traditional Name: N-[2-keto-2-[[2-keto-1-methyl-5-(2-thienyl)-3H-1,4-benzodiazepin-3-yl]amino]-1-methyl-ethyl]butyramide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O3S/c1-4-8-17(26)22-13(2)20(27)24-19-21(28)25(3)15-10-6-5-9-14(15)18(23-19)16-11-7-12-29-16/h5-7,9-13,19H,4,8H2,1-3H3,(H,22,26)(H,24,27)