1-[[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[[5-bromanyl-2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(1-benzyl-5-bromo-2-oxo-indolin-3-ylidene)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[5-bromo-2-oxo-1-(phenylmethyl)-3-indolylidene]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(1-benzyl-5-bromo-2-oxoindol-3-ylidene)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(1-benzyl-5-bromo-2-keto-indolin-3-ylidene)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C25H23BrN4OS MolecularWeight: 507.44532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H23BrN4OS/c1-3-18-11-7-8-16(2)22(18)27-25(32)29-28-23-20-14-19(26)12-13-21(20)30(24(23)31)15-17-9-5-4-6-10-17/h4-14H,3,15H2,1-2H3,(H2,27,29,32)