5-(4-chlorophenyl)-N-morpholin-4-ylsulfonyl-4-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-chlorophenyl)-N-morpholin-4-ylsulfonyl-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(4-chlorophenyl)-N-morpholinosulfonyl-4-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-chlorophenyl)-N-(4-morpholinylsulfonyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(4-chlorophenyl)-N-morpholin-4-ylsulfonyl-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(4-chlorophenyl)-N-morpholinosulfonyl-4-phenyl-2-pyrazoline-1-carbothioamide Formula: C20H21ClN4O3S2 MolecularWeight: 464.98874

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN4O3S2/c21-17-8-6-16(7-9-17)19-18(15-4-2-1-3-5-15)14-25(22-19)20(29)23-30(26,27)24-10-12-28-13-11-24/h1-9,18H,10-14H2,(H,23,29)