(4-azanyl-2-sulfanylidene-1,5-dihydro-1,5-benzodiazepin-3-yl)-morpholin-4-yl-methanone

Systemtic Name: (4-azanyl-2-sulfanylidene-1,5-dihydro-1,5-benzodiazepin-3-yl)-morpholin-4-yl-methanone Openeye Name: (4-amino-2-thioxo-1,5-dihydro-1,5-benzodiazepin-3-yl)-morpholino-methanone CAS Name: (4-amino-2-sulfanylidene-1,5-dihydro-1,5-benzodiazepin-3-yl)-(4-morpholinyl)methanone IUPAC Name: (4-amino-2-sulfanylidene-1,5-dihydro-1,5-benzodiazepin-3-yl)-morpholin-4-ylmethanone Traditional Name: (4-amino-2-thioxo-1,5-dihydro-1,5-benzodiazepin-3-yl)-morpholino-methanone Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=C(NC3=CC=CC=C3NC2=S)N

Isomeric SMILES

C1COCCN1C(=O)C2=C(NC3=CC=CC=C3NC2=S)N

InChI

InChI=1S/C14H16N4O2S/c15-12-11(14(19)18-5-7-20-8-6-18)13(21)17-10-4-2-1-3-9(10)16-12/h1-4,16H,5-8,15H2,(H,17,21)