N-(heptan-4-ylideneamino)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(heptan-4-ylideneamino)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-propylbutylideneamino)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(heptan-4-ylideneamino)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(heptan-4-ylideneamino)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-propylbutylideneamino)-3-pyrrolidinosulfonyl-benzamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)CCC

Isomeric SMILES

CCCC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)CCC

InChI

InChI=1S/C18H27N3O3S/c1-3-8-16(9-4-2)19-20-18(22)15-10-7-11-17(14-15)25(23,24)21-12-5-6-13-21/h7,10-11,14H,3-6,8-9,12-13H2,1-2H3,(H,20,22)