1,3-bis[(3-bromophenyl)-indol-1-yl-methyl]thiourea

Systemtic Name: 1,3-bis[(3-bromophenyl)-indol-1-yl-methyl]thiourea Openeye Name: 1,3-bis[(3-bromophenyl)-indol-1-yl-methyl]thiourea CAS Name: 1,3-bis[(3-bromophenyl)-(1-indolyl)methyl]thiourea IUPAC Name: 1,3-bis[(3-bromophenyl)-indol-1-ylmethyl]thiourea Traditional Name: 1,3-bis[(3-bromophenyl)-indol-1-yl-methyl]thiourea Formula: C31H24Br2N4S MolecularWeight: 644.42206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2C(C3=CC(=CC=C3)Br)NC(=S)NC(C4=CC(=CC=C4)Br)N5C=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2C(C3=CC(=CC=C3)Br)NC(=S)NC(C4=CC(=CC=C4)Br)N5C=CC6=CC=CC=C65

InChI

InChI=1S/C31H24Br2N4S/c32-25-11-5-9-23(19-25)29(36-17-15-21-7-1-3-13-27(21)36)34-31(38)35-30(24-10-6-12-26(33)20-24)37-18-16-22-8-2-4-14-28(22)37/h1-20,29-30H,(H2,34,35,38)