[3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxidanylidene-propyl] N,N-diethylcarbamodithioate

Systemtic Name: [3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxidanylidene-propyl] N,N-diethylcarbamodithioate Openeye Name: [3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-oxo-propyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl] ester IUPAC Name: [3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-keto-propyl] ester Formula: C17H23N3OS3 MolecularWeight: 381.57902

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCCC(=O)NC1=C(C2=C(S1)CCCC2)C#N

Isomeric SMILES

CCN(CC)C(=S)SCCC(=O)NC1=C(C2=C(S1)CCCC2)C#N

InChI

InChI=1S/C17H23N3OS3/c1-3-20(4-2)17(22)23-10-9-15(21)19-16-13(11-18)12-7-5-6-8-14(12)24-16/h3-10H2,1-2H3,(H,19,21)