1-(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-3-phenethyl-thiourea

Systemtic Name: 1-(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-3-phenethyl-thiourea Openeye Name: 1-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-phenethyl-thiourea CAS Name: 1-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-phenethylthiourea IUPAC Name: 1-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-phenethylthiourea Traditional Name: 1-(6-bromo-2-keto-1,3-dihydrobenzimidazol-5-yl)-3-phenethyl-thiourea Formula: C16H15BrN4OS MolecularWeight: 391.2855

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=C(C=C3C(=C2)NC(=O)N3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=C(C=C3C(=C2)NC(=O)N3)Br

InChI

InChI=1S/C16H15BrN4OS/c17-11-8-13-14(20-15(22)19-13)9-12(11)21-16(23)18-7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H2,18,21,23)(H2,19,20,22)