N-[(E)-1-(5-chloranylthiophen-2-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-1-(5-chloranylthiophen-2-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-1-(5-chloro-2-thienyl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-1-(5-chloro-2-thiophenyl)ethylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-1-(5-chlorothiophen-2-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-1-(5-chloro-2-thienyl)ethylideneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC=C(S3)Cl

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)/C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O3S2/c1-12(15-7-8-16(18)25-15)19-20-17(22)13-5-4-6-14(11-13)26(23,24)21-9-2-3-10-21/h4-8,11H,2-3,9-10H2,1H3,(H,20,22)/b19-12+