2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide CAS Name: 2-[(4-cyanophenyl)sulfonyl-methylamino]-N-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)sulfonyl-methylamino]-N-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide Formula: C22H23N5O3S2 MolecularWeight: 469.57972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H23N5O3S2/c1-5-10-27-15(2)11-19(16(27)3)20-14-31-22(24-20)25-21(28)13-26(4)32(29,30)18-8-6-17(12-23)7-9-18/h5-9,11,14H,1,10,13H2,2-4H3,(H,24,25,28)