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

Systemtic Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea CAS Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NCCCOC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NCCCOC)C

InChI

InChI=1S/C22H31N3O2S/c1-15-11-17-13-18(21(26)24-20(17)12-16(15)2)14-25(19-7-4-5-8-19)22(28)23-9-6-10-27-3/h11-13,19H,4-10,14H2,1-3H3,(H,23,28)(H,24,26)