N-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(3-methyl-2-thienyl)methyleneamino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-(3-methyl-2-thiophenyl)methylideneamino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(3-methyl-2-thienyl)methyleneamino]-3-piperidinosulfonyl-benzamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(SC=C1)/C=N/NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H21N3O3S2/c1-14-8-11-25-17(14)13-19-20-18(22)15-6-5-7-16(12-15)26(23,24)21-9-3-2-4-10-21/h5-8,11-13H,2-4,9-10H2,1H3,(H,20,22)/b19-13+