N-[4-[[N-(2-dimethylaminoethyl)-N'-prop-2-ynyl-carbamimidoyl]sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[[N-(2-dimethylaminoethyl)-N'-prop-2-ynyl-carbamimidoyl]sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[[N-(2-dimethylaminoethyl)-N'-prop-2-ynyl-carbamimidoyl]sulfamoyl]phenyl]acetamide CAS Name: N-[4-[[(2-dimethylaminoethylamino)-prop-2-ynyliminomethyl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[[N-(2-dimethylaminoethyl)-N'-prop-2-ynylcarbamimidoyl]sulfamoyl]phenyl]acetamide Traditional Name: N-[4-[[N-(2-dimethylaminoethyl)-N'-propargyl-amidino]sulfamoyl]phenyl]acetamide Formula: C16H23N5O3S MolecularWeight: 365.45052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=NCC#C)NCCN(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=NCC#C)NCCN(C)C

InChI

InChI=1S/C16H23N5O3S/c1-5-10-17-16(18-11-12-21(3)4)20-25(23,24)15-8-6-14(7-9-15)19-13(2)22/h1,6-9H,10-12H2,2-4H3,(H,19,22)(H2,17,18,20)