4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-1-carbothioamide Formula: C21H23N3S2 MolecularWeight: 381.55742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H23N3S2/c1-14-7-8-17(15(2)13-14)23-21(25)24-11-9-16(10-12-24)20-22-18-5-3-4-6-19(18)26-20/h3-8,13,16H,9-12H2,1-2H3,(H,23,25)