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

Systemtic Name: 3-chloranyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-benzamide Openeye Name: 3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-methyl-benzamide CAS Name: 3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide IUPAC Name: 3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide Traditional Name: 3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-methyl-benzamide Formula: C18H17ClN2OS MolecularWeight: 344.85838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C=C3)C)Cl

InChI

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