1-[[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]amino]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]amino]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[(1-benzyl-5-bromo-2-oxo-indolin-3-ylidene)amino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[[5-bromo-2-oxo-1-(phenylmethyl)-3-indolylidene]amino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(1-benzyl-5-bromo-2-oxoindol-3-ylidene)amino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[(1-benzyl-5-bromo-2-keto-indolin-3-ylidene)amino]-3-(4-methoxyphenyl)thiourea Formula: C23H19BrN4O2S MolecularWeight: 495.39156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H19BrN4O2S/c1-30-18-10-8-17(9-11-18)25-23(31)27-26-21-19-13-16(24)7-12-20(19)28(22(21)29)14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H2,25,27,31)