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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3O2S/c1-9-2-7-13-12(8-9)14(15(19)22)16(24-13)21-17(23)20-11-5-3-10(18)4-6-11/h3-6,9H,2,7-8H2,1H3,(H2,19,22)(H2,20,21,23)