2-[2-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidino]propanoylamino]thiophene-3-carboxamide Formula: C20H21ClN4O2S2 MolecularWeight: 448.98934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C20H21ClN4O2S2/c1-11(18(27)24-20-14(17(22)26)6-9-28-20)25-7-4-12(5-8-25)19-23-15-10-13(21)2-3-16(15)29-19/h2-3,6,9-12H,4-5,7-8H2,1H3,(H2,22,26)(H,24,27)