N-(2-azanylethyl)-1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(4-methylphenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(4-methylphenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(4-methylbenzoyl)imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-3-[(4-methylphenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-3-(4-methylbenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-p-toluoyl-imidazolidine-2-carboxamide Formula: C19H25ClN6O4S MolecularWeight: 468.9576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)C3=C(N(N=C3C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)C3=C(N(N=C3C)C)Cl

InChI

InChI=1S/C19H25ClN6O4S/c1-12-4-6-14(7-5-12)19(28)25-10-11-26(18(25)17(27)22-9-8-21)31(29,30)15-13(2)23-24(3)16(15)20/h4-7,18H,8-11,21H2,1-3H3,(H,22,27)