1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethylthiourea Traditional Name: 1-benzyl-3-ethyl-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3OS/c1-4-23-22(27)25(13-17-8-6-5-7-9-17)14-19-12-18-11-10-15(2)16(3)20(18)24-21(19)26/h5-12H,4,13-14H2,1-3H3,(H,23,27)(H,24,26)