1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]-3-phenyl-thiourea Formula: C16H15N5OS2 MolecularWeight: 357.4532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H15N5OS2/c22-14(20-21-15(23)17-11-6-2-1-3-7-11)10-24-16-18-12-8-4-5-9-13(12)19-16/h1-9H,10H2,(H,18,19)(H,20,22)(H2,17,21,23)