1-[7-azanyl-3-cyano-4-[(5-methoxy-2-methyl-phenyl)amino]quinolin-6-yl]-1-(2-morpholin-4-ylethyl)thiourea

Systemtic Name: 1-[7-azanyl-3-cyano-4-[(5-methoxy-2-methyl-phenyl)amino]quinolin-6-yl]-1-(2-morpholin-4-ylethyl)thiourea Openeye Name: 1-[7-amino-3-cyano-4-(5-methoxy-2-methyl-anilino)-6-quinolyl]-1-(2-morpholinoethyl)thiourea CAS Name: 1-[7-amino-3-cyano-4-(5-methoxy-2-methylanilino)-6-quinolinyl]-1-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-[7-amino-3-cyano-4-(5-methoxy-2-methylanilino)quinolin-6-yl]-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 1-[7-amino-3-cyano-4-(5-methoxy-2-methyl-anilino)-6-quinolyl]-1-(2-morpholinoethyl)thiourea Formula: C25H29N7O2S MolecularWeight: 491.60846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)NC2=C(C=NC3=CC(=C(C=C32)N(CCN4CCOCC4)C(=S)N)N)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)OC)NC2=C(C=NC3=CC(=C(C=C32)N(CCN4CCOCC4)C(=S)N)N)C#N

InChI

InChI=1S/C25H29N7O2S/c1-16-3-4-18(33-2)11-21(16)30-24-17(14-26)15-29-22-13-20(27)23(12-19(22)24)32(25(28)35)6-5-31-7-9-34-10-8-31/h3-4,11-13,15H,5-10,27H2,1-2H3,(H2,28,35)(H,29,30)