[4-(4-propylphenyl)sulfonylpiperazin-1-yl] N-(4-carbamimidoylphenyl)carbamate

Systemtic Name: [4-(4-propylphenyl)sulfonylpiperazin-1-yl] N-(4-carbamimidoylphenyl)carbamate Openeye Name: [4-(4-propylphenyl)sulfonylpiperazin-1-yl] N-(4-carbamimidoylphenyl)carbamate CAS Name: N-(4-carbamimidoylphenyl)carbamic acid [4-(4-propylphenyl)sulfonyl-1-piperazinyl] ester IUPAC Name: [4-(4-propylphenyl)sulfonylpiperazin-1-yl] N-(4-carbamimidoylphenyl)carbamate Traditional Name: N-(4-amidinophenyl)carbamic acid [4-(4-propylphenyl)sulfonylpiperazino] ester Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)OC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)OC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H27N5O4S/c1-2-3-16-4-10-19(11-5-16)31(28,29)26-14-12-25(13-15-26)30-21(27)24-18-8-6-17(7-9-18)20(22)23/h4-11H,2-3,12-15H2,1H3,(H3,22,23)(H,24,27)