3-chloranyl-N-(3-oxidanylidene-3-thiomorpholin-4-yl-propyl)-N-phenyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide

Systemtic Name: 3-chloranyl-N-(3-oxidanylidene-3-thiomorpholin-4-yl-propyl)-N-phenyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide Openeye Name: 3-chloro-N-(3-oxo-3-thiomorpholino-propyl)-N-phenyl-5-[2-(4-pyridylamino)ethoxy]benzamide CAS Name: 3-chloro-N-(3-oxo-3-thiomorpholin-4-ylpropyl)-N-phenyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide IUPAC Name: 3-chloro-N-(3-oxo-3-thiomorpholin-4-ylpropyl)-N-phenyl-5-[2-(pyridin-4-ylamino)ethoxy]benzamide Traditional Name: 3-chloro-N-(3-keto-3-thiomorpholino-propyl)-N-phenyl-5-[2-(4-pyridylamino)ethoxy]benzamide Formula: C27H29ClN4O3S MolecularWeight: 525.06216

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)CCN(C2=CC=CC=C2)C(=O)C3=CC(=CC(=C3)Cl)OCCNC4=CC=NC=C4

Isomeric SMILES

C1CSCCN1C(=O)CCN(C2=CC=CC=C2)C(=O)C3=CC(=CC(=C3)Cl)OCCNC4=CC=NC=C4

InChI

InChI=1S/C27H29ClN4O3S/c28-22-18-21(19-25(20-22)35-15-11-30-23-6-9-29-10-7-23)27(34)32(24-4-2-1-3-5-24)12-8-26(33)31-13-16-36-17-14-31/h1-7,9-10,18-20H,8,11-17H2,(H,29,30)