1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methylpiperidin-3-yl)methoxy]quinazolin-4-yl]thiourea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methylpiperidin-3-yl)methoxy]quinazolin-4-yl]thiourea Openeye Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methyl-3-piperidyl)methoxy]quinazolin-4-yl]thiourea CAS Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methyl-3-piperidinyl)methoxy]-4-quinazolinyl]thiourea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methylpiperidin-3-yl)methoxy]quinazolin-4-yl]thiourea Traditional Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[(1-methyl-3-piperidyl)methoxy]quinazolin-4-yl]thiourea Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4CCCN(C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4CCCN(C4)C

InChI

InChI=1S/C25H31N5O2S/c1-16-7-5-8-17(2)23(16)28-25(33)29-24-19-11-21(31-4)22(12-20(19)26-15-27-24)32-14-18-9-6-10-30(3)13-18/h5,7-8,11-12,15,18H,6,9-10,13-14H2,1-4H3,(H2,26,27,28,29,33)