2-[(4S)-4-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-5-piperazin-1-yl-pentyl]guanidine

Systemtic Name: 2-[(4S)-4-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-5-piperazin-1-yl-pentyl]guanidine Openeye Name: 2-[(4S)-4-(1-naphthylsulfonylamino)-5-oxo-5-piperazin-1-yl-pentyl]guanidine CAS Name: 2-[(4S)-4-(1-naphthalenylsulfonylamino)-5-oxo-5-(1-piperazinyl)pentyl]guanidine IUPAC Name: 2-[(4S)-4-(naphthalen-1-ylsulfonylamino)-5-oxo-5-piperazin-1-ylpentyl]guanidine Traditional Name: 2-[(4S)-5-keto-4-(1-naphthylsulfonylamino)-5-piperazino-pentyl]guanidine Formula: C20H28N6O3S MolecularWeight: 432.53972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(CCCN=C(N)N)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1CN(CCN1)C(=O)[C@H](CCCN=C(N)N)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C20H28N6O3S/c21-20(22)24-10-4-8-17(19(27)26-13-11-23-12-14-26)25-30(28,29)18-9-3-6-15-5-1-2-7-16(15)18/h1-3,5-7,9,17,23,25H,4,8,10-14H2,(H4,21,22,24)/t17-/m0/s1