N-[(5-chloranylthiophen-2-yl)methyl]-1-(1-methylpyrrol-3-yl)sulfonyl-N-prop-2-enyl-piperidine-4-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-1-(1-methylpyrrol-3-yl)sulfonyl-N-prop-2-enyl-piperidine-4-carboxamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-1-[(1-methyl-3-pyrrolyl)sulfonyl]-N-prop-2-enyl-4-piperidinecarboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-1-(1-methylpyrrol-3-yl)sulfonyl-N-prop-2-enylpiperidine-4-carboxamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-1-(1-methylpyrrol-3-yl)sulfonyl-isonipecotamide Formula: C19H24ClN3O3S2 MolecularWeight: 441.99516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C19H24ClN3O3S2/c1-3-9-22(13-16-4-5-18(20)27-16)19(24)15-6-11-23(12-7-15)28(25,26)17-8-10-21(2)14-17/h3-5,8,10,14-15H,1,6-7,9,11-13H2,2H3