5-(3,4-dimethoxyphenyl)-3-methyl-4-morpholin-4-yl-2-pyrrol-1-yl-benzenecarbothioamide

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-methyl-4-morpholin-4-yl-2-pyrrol-1-yl-benzenecarbothioamide Openeye Name: 5-(3,4-dimethoxyphenyl)-3-methyl-4-morpholino-2-pyrrol-1-yl-benzenecarbothioamide CAS Name: 5-(3,4-dimethoxyphenyl)-3-methyl-4-(4-morpholinyl)-2-(1-pyrrolyl)benzenecarbothioamide IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-methyl-4-morpholin-4-yl-2-pyrrol-1-ylbenzenecarbothioamide Traditional Name: 5-(3,4-dimethoxyphenyl)-3-methyl-4-morpholino-2-pyrrol-1-yl-thiobenzamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1N2C=CC=C2)C(=S)N)C3=CC(=C(C=C3)OC)OC)N4CCOCC4

Isomeric SMILES

CC1=C(C(=CC(=C1N2C=CC=C2)C(=S)N)C3=CC(=C(C=C3)OC)OC)N4CCOCC4

InChI

InChI=1S/C24H27N3O3S/c1-16-22(27-10-12-30-13-11-27)18(17-6-7-20(28-2)21(14-17)29-3)15-19(24(25)31)23(16)26-8-4-5-9-26/h4-9,14-15H,10-13H2,1-3H3,(H2,25,31)