N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-5-(1-piperidylsulfonyl)-2-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-5-(1-piperidinylsulfonyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-5-piperidinosulfonyl-2-pyrrolidino-benzamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)NCC(=O)NC4CC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)NCC(=O)NC4CC4

InChI

InChI=1S/C21H30N4O4S/c26-20(23-16-6-7-16)15-22-21(27)18-14-17(8-9-19(18)24-10-4-5-11-24)30(28,29)25-12-2-1-3-13-25/h8-9,14,16H,1-7,10-13,15H2,(H,22,27)(H,23,26)