2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-N-ethyl-3-(2-methylphenyl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidine-1-carboxamide

Systemtic Name: 2-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-N-ethyl-3-(2-methylphenyl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidine-1-carboxamide Openeye Name: 2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-ethyl-3-(2-methylbenzoyl)-4-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide CAS Name: 2-(5-chloro-1,3-dimethyl-4-pyrazolyl)-N-ethyl-3-[(2-methylphenyl)-oxomethyl]-4-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-1-pyrrolidinecarboxamide IUPAC Name: 2-(5-chloro-1,3-dimethylpyrazol-4-yl)-N-ethyl-3-(2-methylbenzoyl)-4-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide Traditional Name: 2-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-N-ethyl-4-(3-methyl-2-thienyl)-3-o-toluoyl-5-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide Formula: C30H37ClN6O3S MolecularWeight: 597.17118

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=C(C=CS3)C)C(=O)C4=CC=CC=C4C)C5=C(N(N=C5C)C)Cl

Isomeric SMILES

CCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=C(C=CS3)C)C(=O)C4=CC=CC=C4C)C5=C(N(N=C5C)C)Cl

InChI

InChI=1S/C30H37ClN6O3S/c1-6-33-30(40)37-24(21-19(4)34-35(5)28(21)31)22(26(38)20-10-8-7-9-17(20)2)23(27-18(3)11-16-41-27)25(37)29(39)36-14-12-32-13-15-36/h7-11,16,22-25,32H,6,12-15H2,1-5H3,(H,33,40)