4-(4-chlorophenyl)-5-ethanoyl-6-methylidene-3-prop-2-enyl-2-sulfanylidene-piperidine-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-5-ethanoyl-6-methylidene-3-prop-2-enyl-2-sulfanylidene-piperidine-3-carbonitrile Openeye Name: 5-acetyl-3-allyl-4-(4-chlorophenyl)-6-methylene-2-thioxo-piperidine-3-carbonitrile CAS Name: 5-acetyl-4-(4-chlorophenyl)-6-methylene-3-prop-2-enyl-2-sulfanylidene-3-piperidinecarbonitrile IUPAC Name: 5-acetyl-4-(4-chlorophenyl)-6-methylidene-3-prop-2-enyl-2-sulfanylidenepiperidine-3-carbonitrile Traditional Name: 5-acetyl-3-allyl-4-(4-chlorophenyl)-6-methylene-2-thioxo-nipecotonitrile Formula: C18H17ClN2OS MolecularWeight: 344.85838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(C(=S)NC1=C)(CC=C)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)C1C(C(C(=S)NC1=C)(CC=C)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H17ClN2OS/c1-4-9-18(10-20)16(13-5-7-14(19)8-6-13)15(12(3)22)11(2)21-17(18)23/h4-8,15-16H,1-2,9H2,3H3,(H,21,23)