N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-[(4-methoxyphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-[(4-methoxyphenyl)methylsulfanyl]ethanamide Openeye Name: N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-[(4-methoxyphenyl)methylsulfanyl]acetamide CAS Name: N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-[(4-methoxyphenyl)methylthio]acetamide IUPAC Name: N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-[(4-methoxyphenyl)methylsulfanyl]acetamide Traditional Name: N-[(E)-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-(p-anisylthio)acetamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)CSCC3=CC=C(C=C3)OC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=C2C)/C=N/NC(=O)CSCC3=CC=C(C=C3)OC)C)C

InChI

InChI=1S/C25H29N3O2S/c1-17-6-11-24(18(2)12-17)28-19(3)13-22(20(28)4)14-26-27-25(29)16-31-15-21-7-9-23(30-5)10-8-21/h6-14H,15-16H2,1-5H3,(H,27,29)/b26-14+