1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-methyl-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-methyl-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methyl-thiourea CAS Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methyl-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methylthiourea Traditional Name: 1-benzyl-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-3-methyl-thiourea Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3OS/c1-14-9-10-15(2)19-18(14)11-17(20(25)23-19)13-24(21(26)22-3)12-16-7-5-4-6-8-16/h4-11H,12-13H2,1-3H3,(H,22,26)(H,23,25)