[(E)-(1-methyl-5-morpholin-4-yl-2-oxidanylidene-1,4-benzodiazepin-3-ylidene)amino] N-ethylcarbamate

Systemtic Name: [(E)-(1-methyl-5-morpholin-4-yl-2-oxidanylidene-1,4-benzodiazepin-3-ylidene)amino] N-ethylcarbamate Openeye Name: [(E)-(1-methyl-5-morpholino-2-oxo-1,4-benzodiazepin-3-ylidene)amino] N-ethylcarbamate CAS Name: N-ethylcarbamic acid [(E)-[1-methyl-5-(4-morpholinyl)-2-oxo-1,4-benzodiazepin-3-ylidene]amino] ester IUPAC Name: [(E)-(1-methyl-5-morpholin-4-yl-2-oxo-1,4-benzodiazepin-3-ylidene)amino] N-ethylcarbamate Traditional Name: N-ethylcarbamic acid [(E)-(2-keto-1-methyl-5-morpholino-1,4-benzodiazepin-3-ylidene)amino] ester Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)ON=C1C(=O)N(C2=CC=CC=C2C(=N1)N3CCOCC3)C

Isomeric SMILES

CCNC(=O)O/N=C/1\C(=O)N(C2=CC=CC=C2C(=N1)N3CCOCC3)C

InChI

InChI=1S/C17H21N5O4/c1-3-18-17(24)26-20-14-16(23)21(2)13-7-5-4-6-12(13)15(19-14)22-8-10-25-11-9-22/h4-7H,3,8-11H2,1-2H3,(H,18,24)/b20-14+