1-(2-diethylaminoethyl)-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea

Systemtic Name: 1-(2-diethylaminoethyl)-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-(2-diethylaminoethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-(2-diethylaminoethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-(2-diethylaminoethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea Traditional Name: 1-(2-diethylaminoethyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Formula: C27H36N4O3S MolecularWeight: 496.66474

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H36N4O3S/c1-5-30(6-2)14-15-31(27(35)28-13-12-20-10-8-7-9-11-20)19-22-16-21-17-24(33-3)25(34-4)18-23(21)29-26(22)32/h7-11,16-18H,5-6,12-15,19H2,1-4H3,(H,28,35)(H,29,32)