N-(3,4-dimethylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethylphenyl)-4-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: N-(3,4-dimethylphenyl)-4-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(3,4-dimethylphenyl)-4-(2-furfuryl)piperazine-1-carbothioamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3)C

InChI

InChI=1S/C18H23N3OS/c1-14-5-6-16(12-15(14)2)19-18(23)21-9-7-20(8-10-21)13-17-4-3-11-22-17/h3-6,11-12H,7-10,13H2,1-2H3,(H,19,23)