1-(3-methoxyphenyl)-3-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)urea

Systemtic Name: 1-(3-methoxyphenyl)-3-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Openeye Name: 1-(3-methoxyphenyl)-3-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)urea CAS Name: 1-(3-methoxyphenyl)-3-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-(3-methoxyphenyl)-3-(5-phenyl-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-(3-methoxyphenyl)-3-(5-phenyl-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2C(=S)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2C(=S)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2S/c1-29-17-11-7-10-16(14-17)24-23(28)27-21-22(30)25-19-13-6-5-12-18(19)20(26-21)15-8-3-2-4-9-15/h2-14,21H,1H3,(H,25,30)(H2,24,27,28)