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

Systemtic Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea Traditional Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Formula: C27H36N4O2S MolecularWeight: 480.66534

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H36N4O2S/c1-4-30(5-2)16-17-31(27(34)28-15-14-21-10-8-7-9-11-21)20-23-18-22-19-24(33-6-3)12-13-25(22)29-26(23)32/h7-13,18-19H,4-6,14-17,20H2,1-3H3,(H,28,34)(H,29,32)