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

Systemtic Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-benzyl-1-(2-diethylaminoethyl)-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]thiourea Formula: C26H34N4O2S MolecularWeight: 466.63876

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C26H34N4O2S/c1-4-29(5-2)14-15-30(26(33)27-18-20-10-8-7-9-11-20)19-22-16-21-17-23(32-6-3)12-13-24(21)28-25(22)31/h7-13,16-17H,4-6,14-15,18-19H2,1-3H3,(H,27,33)(H,28,31)