N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCOC)C)C=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(N1CCOC)C)/C=N/NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H28N4O4S/c1-16-13-19(17(2)25(16)11-12-29-3)15-22-23-21(26)18-7-6-8-20(14-18)30(27,28)24-9-4-5-10-24/h6-8,13-15H,4-5,9-12H2,1-3H3,(H,23,26)/b22-15+