N-[(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide

Systemtic Name: N-[(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide Openeye Name: N-[(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamothioyl]benzamide CAS Name: N-[[(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide Traditional Name: N-[(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]benzamide Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H17N3OS2/c1-11-7-8-15-13(9-11)14(10-19)17(24-15)21-18(23)20-16(22)12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3,(H2,20,21,22,23)