[3-azanyl-4-(4-methylphenyl)sulfonyl-5-phenylazanyl-thiophen-2-yl]-(1,3-benzodioxol-5-yl)methanone

Systemtic Name: [3-azanyl-4-(4-methylphenyl)sulfonyl-5-phenylazanyl-thiophen-2-yl]-(1,3-benzodioxol-5-yl)methanone Openeye Name: [3-amino-5-anilino-4-(p-tolylsulfonyl)-2-thienyl]-(1,3-benzodioxol-5-yl)methanone CAS Name: [3-amino-5-anilino-4-(4-methylphenyl)sulfonyl-2-thiophenyl]-(1,3-benzodioxol-5-yl)methanone IUPAC Name: [3-amino-5-anilino-4-(4-methylphenyl)sulfonylthiophen-2-yl]-(1,3-benzodioxol-5-yl)methanone Traditional Name: (3-amino-5-anilino-4-tosyl-2-thienyl)-(1,3-benzodioxol-5-yl)methanone Formula: C25H20N2O5S2 MolecularWeight: 492.5667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)C3=CC4=C(C=C3)OCO4)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=C2N)C(=O)C3=CC4=C(C=C3)OCO4)NC5=CC=CC=C5

InChI

InChI=1S/C25H20N2O5S2/c1-15-7-10-18(11-8-15)34(29,30)24-21(26)23(33-25(24)27-17-5-3-2-4-6-17)22(28)16-9-12-19-20(13-16)32-14-31-19/h2-13,27H,14,26H2,1H3