5-methyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-methyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-methyl-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C21H24N2O2S/c1-14-4-9-18-16(12-14)13-19(26-18)20(24)22-17-7-5-15(6-8-17)21(25)23-10-2-3-11-23/h5-8,13-14H,2-4,9-12H2,1H3,(H,22,24)