1-[2-(2-butylbenzimidazol-1-yl)ethanoylamino]-3-(3-ethylphenyl)thiourea

Systemtic Name: 1-[2-(2-butylbenzimidazol-1-yl)ethanoylamino]-3-(3-ethylphenyl)thiourea Openeye Name: 1-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-3-(3-ethylphenyl)thiourea CAS Name: 1-[[2-(2-butyl-1-benzimidazolyl)-1-oxoethyl]amino]-3-(3-ethylphenyl)thiourea IUPAC Name: 1-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-3-(3-ethylphenyl)thiourea Traditional Name: 1-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-3-(3-ethylphenyl)thiourea Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC(=O)NNC(=S)NC3=CC=CC(=C3)CC

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC(=O)NNC(=S)NC3=CC=CC(=C3)CC

InChI

InChI=1S/C22H27N5OS/c1-3-5-13-20-24-18-11-6-7-12-19(18)27(20)15-21(28)25-26-22(29)23-17-10-8-9-16(4-2)14-17/h6-12,14H,3-5,13,15H2,1-2H3,(H,25,28)(H2,23,26,29)