N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[(S)-(1-methyl-2-imidazolyl)-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(S)-(1-methylimidazol-2-yl)-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3=CC4=C(S3)CCCC4

Isomeric SMILES

CN1C=CN=C1[C@H](C2=CC=CC=C2)NC(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C20H21N3OS/c1-23-12-11-21-19(23)18(14-7-3-2-4-8-14)22-20(24)17-13-15-9-5-6-10-16(15)25-17/h2-4,7-8,11-13,18H,5-6,9-10H2,1H3,(H,22,24)/t18-/m0/s1