1-[2-(benzimidazol-1-yl)ethanoylamino]-3-(3-bromophenyl)thiourea

Systemtic Name: 1-[2-(benzimidazol-1-yl)ethanoylamino]-3-(3-bromophenyl)thiourea Openeye Name: 1-[[2-(benzimidazol-1-yl)acetyl]amino]-3-(3-bromophenyl)thiourea CAS Name: 1-[[2-(1-benzimidazolyl)-1-oxoethyl]amino]-3-(3-bromophenyl)thiourea IUPAC Name: 1-[[2-(benzimidazol-1-yl)acetyl]amino]-3-(3-bromophenyl)thiourea Traditional Name: 1-[[2-(benzimidazol-1-yl)acetyl]amino]-3-(3-bromophenyl)thiourea Formula: C16H14BrN5OS MolecularWeight: 404.28426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(=O)NNC(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(=O)NNC(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H14BrN5OS/c17-11-4-3-5-12(8-11)19-16(24)21-20-15(23)9-22-10-18-13-6-1-2-7-14(13)22/h1-8,10H,9H2,(H,20,23)(H2,19,21,24)