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

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)piperidine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)piperidine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(4-ethoxyphenyl)piperidine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-p-phenetyl-piperidine-1-carbothioamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3OS2/c1-2-25-17-9-7-16(8-10-17)22-21(26)24-13-11-15(12-14-24)20-23-18-5-3-4-6-19(18)27-20/h3-10,15H,2,11-14H2,1H3,(H,22,26)