N-[2-(cyclohexen-1-yl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H26N2O3S2/c25-22(23-13-10-17-6-2-1-3-7-17)21-20(12-15-28-21)29(26,27)24-14-11-18-8-4-5-9-19(18)16-24/h4-6,8-9,12,15H,1-3,7,10-11,13-14,16H2,(H,23,25)