4-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)piperidine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)piperidine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)piperidine-1-carbothioamide Formula: C20H20FN3S2 MolecularWeight: 385.521303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20FN3S2/c1-13-6-7-15(12-16(13)21)22-20(25)24-10-8-14(9-11-24)19-23-17-4-2-3-5-18(17)26-19/h2-7,12,14H,8-11H2,1H3,(H,22,25)