3-butyl-1-(2-dimethylaminoethyl)-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-butyl-1-(2-dimethylaminoethyl)-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-butyl-1-(2-dimethylaminoethyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-butyl-1-(2-dimethylaminoethyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-butyl-1-(2-dimethylaminoethyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-butyl-1-(2-dimethylaminoethyl)-1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CCN(C)C)CC1=CC2=CC(=C(C=C2NC1=O)C)C

Isomeric SMILES

CCCCNC(=S)N(CCN(C)C)CC1=CC2=CC(=C(C=C2NC1=O)C)C

InChI

InChI=1S/C21H32N4OS/c1-6-7-8-22-21(27)25(10-9-24(4)5)14-18-13-17-11-15(2)16(3)12-19(17)23-20(18)26/h11-13H,6-10,14H2,1-5H3,(H,22,27)(H,23,26)