2-[(3-chlorophenyl)carbamoylamino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)carbamoylamino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(3-chlorophenyl)carbamoylamino]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(3-chlorophenyl)carbamoylamino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H18ClN3O2S MolecularWeight: 363.86172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)NC3=CC(=CC=C3)Cl)C(=O)N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)NC(=O)NC3=CC(=CC=C3)Cl)C(=O)N

InChI

InChI=1S/C17H18ClN3O2S/c1-9-5-6-13-12(7-9)14(15(19)22)16(24-13)21-17(23)20-11-4-2-3-10(18)8-11/h2-4,8-9H,5-7H2,1H3,(H2,19,22)(H2,20,21,23)