1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ylethyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ylethyl)thiourea Openeye Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholinoethyl)thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 3-ethyl-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-1-(2-morpholinoethyl)thiourea Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CCN1CCOCC1)CC2=CC3=C(C(=C(C=C3)C)C)NC2=O

Isomeric SMILES

CCNC(=S)N(CCN1CCOCC1)CC2=CC3=C(C(=C(C=C3)C)C)NC2=O

InChI

InChI=1S/C21H30N4O2S/c1-4-22-21(28)25(8-7-24-9-11-27-12-10-24)14-18-13-17-6-5-15(2)16(3)19(17)23-20(18)26/h5-6,13H,4,7-12,14H2,1-3H3,(H,22,28)(H,23,26)