6-tert-butyl-2-[(3-chlorophenyl)carbonylamino]-N-prop-2-enyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-tert-butyl-2-[(3-chlorophenyl)carbonylamino]-N-prop-2-enyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-allyl-6-tert-butyl-2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-tert-butyl-2-[[(3-chlorophenyl)-oxomethyl]amino]-N-prop-2-enyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-tert-butyl-2-[(3-chlorobenzoyl)amino]-N-prop-2-enyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-allyl-6-tert-butyl-2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H27ClN2O2S MolecularWeight: 430.99068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NCC=C)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NCC=C)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H27ClN2O2S/c1-5-11-25-21(28)19-17-10-9-15(23(2,3)4)13-18(17)29-22(19)26-20(27)14-7-6-8-16(24)12-14/h5-8,12,15H,1,9-11,13H2,2-4H3,(H,25,28)(H,26,27)