N-[(5-chloranylthiophen-2-yl)methyl]-4-methyl-3-piperidin-1-ylsulfonyl-N-prop-2-enyl-benzamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-4-methyl-3-piperidin-1-ylsulfonyl-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-4-methyl-3-(1-piperidinylsulfonyl)-N-prop-2-enylbenzamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-4-methyl-3-piperidin-1-ylsulfonyl-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C21H25ClN2O3S2 MolecularWeight: 453.0178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC=C)CC2=CC=C(S2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC=C)CC2=CC=C(S2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25ClN2O3S2/c1-3-11-23(15-18-9-10-20(22)28-18)21(25)17-8-7-16(2)19(14-17)29(26,27)24-12-5-4-6-13-24/h3,7-10,14H,1,4-6,11-13,15H2,2H3