N-(3-chlorophenyl)-5-[4-(2-pyrrolidin-1-ylethylcarbamoyl)piperidin-1-yl]carbonyl-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(3-chlorophenyl)-5-[4-(2-pyrrolidin-1-ylethylcarbamoyl)piperidin-1-yl]carbonyl-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(3-chlorophenyl)-5-[4-(2-pyrrolidin-1-ylethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(3-chlorophenyl)-5-[oxo-[4-[oxo-[2-(1-pyrrolidinyl)ethylamino]methyl]-1-piperidinyl]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(3-chlorophenyl)-5-[4-(2-pyrrolidin-1-ylethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(3-chlorophenyl)-5-[4-(2-pyrrolidinoethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Formula: C22H27ClN6O3S MolecularWeight: 491.00618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2CCN(CC2)C(=O)C3=NN=C(S3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2CCN(CC2)C(=O)C3=NN=C(S3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H27ClN6O3S/c23-16-4-3-5-17(14-16)25-19(31)20-26-27-21(33-20)22(32)29-11-6-15(7-12-29)18(30)24-8-13-28-9-1-2-10-28/h3-5,14-15H,1-2,6-13H2,(H,24,30)(H,25,31)