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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCCC(C2)C3=NC4=C(N3)C=C(C(=C4)C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCC[C@H](C2)C3=NC4=C(N3)C=C(C(=C4)C)C

InChI

InChI=1S/C23H28N4S/c1-4-17-8-5-6-10-19(17)26-23(28)27-11-7-9-18(14-27)22-24-20-12-15(2)16(3)13-21(20)25-22/h5-6,8,10,12-13,18H,4,7,9,11,14H2,1-3H3,(H,24,25)(H,26,28)/t18-/m1/s1