3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidin-1-ylethyl)thiourea

Systemtic Name: 3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidin-1-ylethyl)thiourea Openeye Name: 3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidin-1-ylethyl)thiourea CAS Name: 3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(1-pyrrolidinyl)ethyl]thiourea IUPAC Name: 3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidin-1-ylethyl)thiourea Traditional Name: 3-(2,4-dimethoxyphenyl)-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidinoethyl)thiourea Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCN3CCCC3)C(=S)NC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCN3CCCC3)C(=S)NC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C27H34N4O4S/c1-4-35-22-8-9-23-19(16-22)15-20(26(32)28-23)18-31(14-13-30-11-5-6-12-30)27(36)29-24-10-7-21(33-2)17-25(24)34-3/h7-10,15-17H,4-6,11-14,18H2,1-3H3,(H,28,32)(H,29,36)