3-chloranyl-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(S)-(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzothiophene-2-carboxamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CN1C=CN=C1[C@H](C2=CC=C(C=C2)OC)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-25-12-11-23-20(25)18(13-7-9-14(27-2)10-8-13)24-21(26)19-17(22)15-5-3-4-6-16(15)28-19/h3-12,18H,1-2H3,(H,24,26)/t18-/m0/s1