1-(3-chloranyl-2-methyl-phenyl)-3-[2-(1-methylbenzimidazol-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[2-(1-methylbenzimidazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[2-(1-methyl-2-benzimidazolyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]thiourea Formula: C18H18ClN5OS MolecularWeight: 387.88642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)CC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)CC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C18H18ClN5OS/c1-11-12(19)6-5-8-13(11)21-18(26)23-22-17(25)10-16-20-14-7-3-4-9-15(14)24(16)2/h3-9H,10H2,1-2H3,(H,22,25)(H2,21,23,26)