N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-4-methyl-benzamide

Systemtic Name: N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-4-methyl-benzamide Openeye Name: N-[1-[(3-methoxyphenyl)carbamothioyl]-4-piperidyl]-4-methyl-benzamide CAS Name: N-[1-[(3-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-4-methylbenzamide IUPAC Name: N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-4-methylbenzamide Traditional Name: N-[1-[(3-methoxyphenyl)thiocarbamoyl]-4-piperidyl]-4-methyl-benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H25N3O2S/c1-15-6-8-16(9-7-15)20(25)22-17-10-12-24(13-11-17)21(27)23-18-4-3-5-19(14-18)26-2/h3-9,14,17H,10-13H2,1-2H3,(H,22,25)(H,23,27)