3-(2-ethylphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(2-ethylphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)thiourea Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CN=CC=C2)CC3=CC4=C(C=CC(=C4)C)NC3=O

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CN=CC=C2)CC3=CC4=C(C=CC(=C4)C)NC3=O

InChI

InChI=1S/C26H26N4OS/c1-3-20-8-4-5-9-23(20)29-26(32)30(16-19-7-6-12-27-15-19)17-22-14-21-13-18(2)10-11-24(21)28-25(22)31/h4-15H,3,16-17H2,1-2H3,(H,28,31)(H,29,32)