1-[(4Z)-2-chloranyl-4-[6-cyano-2-methoxy-7-(1-methylpiperidin-4-yl)-1H-quinolin-4-ylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-cyclopropyl-urea

Systemtic Name: 1-[(4Z)-2-chloranyl-4-[6-cyano-2-methoxy-7-(1-methylpiperidin-4-yl)-1H-quinolin-4-ylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-cyclopropyl-urea Openeye Name: 1-[(4Z)-2-chloro-4-[6-cyano-2-methoxy-7-(1-methyl-4-piperidyl)-1H-quinolin-4-ylidene]-3-oxo-cyclohexa-1,5-dien-1-yl]-3-cyclopropyl-urea CAS Name: 1-[(4Z)-2-chloro-4-[6-cyano-2-methoxy-7-(1-methyl-4-piperidinyl)-1H-quinolin-4-ylidene]-3-oxo-1-cyclohexa-1,5-dienyl]-3-cyclopropylurea IUPAC Name: 1-[(4Z)-2-chloro-4-[6-cyano-2-methoxy-7-(1-methylpiperidin-4-yl)-1H-quinolin-4-ylidene]-3-oxocyclohexa-1,5-dien-1-yl]-3-cyclopropylurea Traditional Name: 1-[(4Z)-2-chloro-4-[6-cyano-2-methoxy-7-(1-methyl-4-piperidyl)-1H-quinolin-4-ylidene]-3-keto-cyclohexa-1,5-dien-1-yl]-3-cyclopropyl-urea Formula: C27H28ClN5O3 MolecularWeight: 505.99592

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=CC3=C(C=C2C#N)C(=C4C=CC(=C(C4=O)Cl)NC(=O)NC5CC5)C=C(N3)OC

Isomeric SMILES

CN1CCC(CC1)C2=CC3=C(C=C2C#N)/C(=C\4/C=CC(=C(C4=O)Cl)NC(=O)NC5CC5)/C=C(N3)OC

InChI

InChI=1S/C27H28ClN5O3/c1-33-9-7-15(8-10-33)19-12-23-21(11-16(19)14-29)20(13-24(31-23)36-2)18-5-6-22(25(28)26(18)34)32-27(35)30-17-3-4-17/h5-6,11-13,15,17,31H,3-4,7-10H2,1-2H3,(H2,30,32,35)/b20-18-