1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-benzyl-3-(3-ethoxypropyl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=C(C=C3NC2=O)C)C

Isomeric SMILES

CCOCCCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=C(C=C3NC2=O)C)C

InChI

InChI=1S/C25H31N3O2S/c1-4-30-12-8-11-26-25(31)28(16-20-9-6-5-7-10-20)17-21-15-22-19(3)13-18(2)14-23(22)27-24(21)29/h5-7,9-10,13-15H,4,8,11-12,16-17H2,1-3H3,(H,26,31)(H,27,29)