(3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)piperidine-1-carbothioamide

Systemtic Name: (3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)piperidine-1-carbothioamide Openeye Name: (3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)piperidine-1-carbothioamide CAS Name: (3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)-1-piperidinecarbothioamide IUPAC Name: (3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)piperidine-1-carbothioamide Traditional Name: (3R)-3-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-ethylphenyl)piperidine-1-carbothioamide Formula: C23H28N4S MolecularWeight: 392.56022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N2CCCC(C2)C3=NC4=C(N3)C=C(C(=C4)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N2CCC[C@H](C2)C3=NC4=C(N3)C=C(C(=C4)C)C

InChI

InChI=1S/C23H28N4S/c1-4-17-7-9-19(10-8-17)24-23(28)27-11-5-6-18(14-27)22-25-20-12-15(2)16(3)13-21(20)26-22/h7-10,12-13,18H,4-6,11,14H2,1-3H3,(H,24,28)(H,25,26)/t18-/m1/s1