N-[3-(azepan-1-yl)propyl]-4-[4-oxidanylidene-3-(phenylmethyl)-1,3-thiazolidin-2-yl]benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-[4-oxidanylidene-3-(phenylmethyl)-1,3-thiazolidin-2-yl]benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-(3-benzyl-4-oxo-thiazolidin-2-yl)benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[4-oxo-3-(phenylmethyl)-2-thiazolidinyl]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-(3-benzyl-4-keto-thiazolidin-2-yl)benzamide Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)C3N(C(=O)CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC=C(C=C2)C3N(C(=O)CS3)CC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2S/c30-24-20-32-26(29(24)19-21-9-4-3-5-10-21)23-13-11-22(12-14-23)25(31)27-15-8-18-28-16-6-1-2-7-17-28/h3-5,9-14,26H,1-2,6-8,15-20H2,(H,27,31)