2-[[1-(4-nitrophenyl)cyclopentyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[[1-(4-nitrophenyl)cyclopentyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[1-(4-nitrophenyl)cyclopentanecarbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[[1-(4-nitrophenyl)cyclopentyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[1-(4-nitrophenyl)cyclopentanecarbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[1-(4-nitrophenyl)cyclopentanecarbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3(CCCC3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3(CCCC3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C21H23N3O4S/c22-18(25)17-15-5-1-2-6-16(15)29-19(17)23-20(26)21(11-3-4-12-21)13-7-9-14(10-8-13)24(27)28/h7-10H,1-6,11-12H2,(H2,22,25)(H,23,26)