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

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[3-(2-thiophen-3-ylethoxy)phenyl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-N-[[3-[2-(3-thienyl)ethoxy]phenyl]methyl]thiazole-5-carboxamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-N-[[3-[2-(3-thiophenyl)ethoxy]phenyl]methyl]-5-thiazolecarboxamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-N-[[3-(2-thiophen-3-ylethoxy)phenyl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-N-[3-[2-(3-thienyl)ethoxy]benzyl]thiazole-5-carboxamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC(=CC=C2)OCCC3=CSC=C3)C(=O)C4=CN=CS4

Isomeric SMILES

C1CCNC(=O)[C@H](C1)N(CC2=CC(=CC=C2)OCCC3=CSC=C3)C(=O)C4=CN=CS4

InChI

InChI=1S/C23H25N3O3S2/c27-22-20(6-1-2-9-25-22)26(23(28)21-13-24-16-31-21)14-18-4-3-5-19(12-18)29-10-7-17-8-11-30-15-17/h3-5,8,11-13,15-16,20H,1-2,6-7,9-10,14H2,(H,25,27)/t20-/m0/s1