N2-(2-azanylethyl)-N1-(4-methylphenyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-N1-(4-methylphenyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-N1-(p-tolyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-N1-(4-methylphenyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-1-N-(4-methylphenyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-N-(p-tolyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C19H25N5O4S2 MolecularWeight: 451.5629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H25N5O4S2/c1-14-5-7-15(8-6-14)22-19(26)23-11-3-12-24(18(23)17(25)21-10-9-20)30(27,28)16-4-2-13-29-16/h2,4-8,13,18H,3,9-12,20H2,1H3,(H,21,25)(H,22,26)