1-(2-methoxyphenyl)-3-[[2-oxidanylidene-1-[(4-phenylpiperazin-1-yl)methyl]indol-3-ylidene]amino]thiourea

Systemtic Name: 1-(2-methoxyphenyl)-3-[[2-oxidanylidene-1-[(4-phenylpiperazin-1-yl)methyl]indol-3-ylidene]amino]thiourea Openeye Name: 1-(2-methoxyphenyl)-3-[[2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]indolin-3-ylidene]amino]thiourea CAS Name: 1-(2-methoxyphenyl)-3-[[2-oxo-1-[(4-phenyl-1-piperazinyl)methyl]-3-indolylidene]amino]thiourea IUPAC Name: 1-(2-methoxyphenyl)-3-[[2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]indol-3-ylidene]amino]thiourea Traditional Name: 1-[[2-keto-1-[(4-phenylpiperazino)methyl]indolin-3-ylidene]amino]-3-(2-methoxyphenyl)thiourea Formula: C27H28N6O2S MolecularWeight: 500.61522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N6O2S/c1-35-24-14-8-6-12-22(24)28-27(36)30-29-25-21-11-5-7-13-23(21)33(26(25)34)19-31-15-17-32(18-16-31)20-9-3-2-4-10-20/h2-14H,15-19H2,1H3,(H2,28,30,36)