ethyl 1-[4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CS3)N(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CS3)N(C)C)C

InChI

InChI=1S/C22H26N4O3S/c1-5-29-22(28)18-13-24-26(15(18)2)17-10-8-16(9-11-17)21(27)23-14-19(25(3)4)20-7-6-12-30-20/h6-13,19H,5,14H2,1-4H3,(H,23,27)