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

Systemtic Name: 1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-oxolanylmethyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-benzyl-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(tetrahydrofurfuryl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CC=C3)C(=S)NCC4CCCO4)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CC=C3)C(=S)NCC4CCCO4)C

InChI

InChI=1S/C25H29N3O2S/c1-17-11-18(2)22-13-20(24(29)27-23(22)12-17)16-28(15-19-7-4-3-5-8-19)25(31)26-14-21-9-6-10-30-21/h3-5,7-8,11-13,21H,6,9-10,14-16H2,1-2H3,(H,26,31)(H,27,29)