1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis(3-morpholinopropyl)thiourea CAS Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-1,3-bis(3-morpholinopropyl)thiourea Formula: C27H41N5O3S MolecularWeight: 515.71114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CCCN3CCOCC3)C(=S)NCCCN4CCOCC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CCCN3CCOCC3)C(=S)NCCCN4CCOCC4)C

InChI

InChI=1S/C27H41N5O3S/c1-21-17-23-19-24(26(33)29-25(23)18-22(21)2)20-32(8-4-7-31-11-15-35-16-12-31)27(36)28-5-3-6-30-9-13-34-14-10-30/h17-19H,3-16,20H2,1-2H3,(H,28,36)(H,29,33)