1-[1,3-bis(oxidanylidene)-2-[(4-phenyl-1,3-thiazol-2-yl)methyl]isoindol-4-yl]-N-prop-2-enyl-piperidine-3-carboxamide

Systemtic Name: 1-[1,3-bis(oxidanylidene)-2-[(4-phenyl-1,3-thiazol-2-yl)methyl]isoindol-4-yl]-N-prop-2-enyl-piperidine-3-carboxamide Openeye Name: N-allyl-1-[1,3-dioxo-2-[(4-phenylthiazol-2-yl)methyl]isoindolin-4-yl]piperidine-3-carboxamide CAS Name: 1-[1,3-dioxo-2-[(4-phenyl-2-thiazolyl)methyl]-4-isoindolyl]-N-prop-2-enyl-3-piperidinecarboxamide IUPAC Name: 1-[1,3-dioxo-2-[(4-phenyl-1,3-thiazol-2-yl)methyl]isoindol-4-yl]-N-prop-2-enylpiperidine-3-carboxamide Traditional Name: N-allyl-1-[1,3-diketo-2-[(4-phenylthiazol-2-yl)methyl]isoindolin-4-yl]nipecotamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1CCCN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=NC(=CS4)C5=CC=CC=C5

Isomeric SMILES

C=CCNC(=O)C1CCCN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=NC(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S/c1-2-13-28-25(32)19-10-7-14-30(15-19)22-12-6-11-20-24(22)27(34)31(26(20)33)16-23-29-21(17-35-23)18-8-4-3-5-9-18/h2-6,8-9,11-12,17,19H,1,7,10,13-16H2,(H,28,32)