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

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethylthiourea Traditional Name: 1-benzyl-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-3-ethyl-thiourea Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=CC(=C3)OCC)NC2=O

Isomeric SMILES

CCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=CC(=C3)OCC)NC2=O

InChI

InChI=1S/C22H25N3O2S/c1-3-23-22(28)25(14-16-8-6-5-7-9-16)15-18-12-17-13-19(27-4-2)10-11-20(17)24-21(18)26/h5-13H,3-4,14-15H2,1-2H3,(H,23,28)(H,24,26)