N-[(3-cyclopentyloxyphenyl)methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazole-5-carboxamide

Systemtic Name: N-[(3-cyclopentyloxyphenyl)methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazole-5-carboxamide Openeye Name: N-[[3-(cyclopentoxy)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]thiazole-5-carboxamide CAS Name: N-[(3-cyclopentyloxyphenyl)methyl]-N-[(3S)-2-oxo-3-azepanyl]-5-thiazolecarboxamide IUPAC Name: N-[(3-cyclopentyloxyphenyl)methyl]-N-[(3S)-2-oxoazepan-3-yl]-1,3-thiazole-5-carboxamide Traditional Name: N-[3-(cyclopentoxy)benzyl]-N-[(3S)-2-ketoazepan-3-yl]thiazole-5-carboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC(=C2)CN(C3CCCCNC3=O)C(=O)C4=CN=CS4

Isomeric SMILES

C1CCNC(=O)[C@H](C1)N(CC2=CC(=CC=C2)OC3CCCC3)C(=O)C4=CN=CS4

InChI

InChI=1S/C22H27N3O3S/c26-21-19(10-3-4-11-24-21)25(22(27)20-13-23-15-29-20)14-16-6-5-9-18(12-16)28-17-7-1-2-8-17/h5-6,9,12-13,15,17,19H,1-4,7-8,10-11,14H2,(H,24,26)/t19-/m0/s1