2-[(4S)-4-azanyl-5-(1-methylimidazol-2-yl)-5-oxidanyl-pentyl]-1-(4-methylphenyl)sulfonyl-guanidine

Systemtic Name: 2-[(4S)-4-azanyl-5-(1-methylimidazol-2-yl)-5-oxidanyl-pentyl]-1-(4-methylphenyl)sulfonyl-guanidine Openeye Name: 2-[(4S)-4-amino-5-hydroxy-5-(1-methylimidazol-2-yl)pentyl]-1-(p-tolylsulfonyl)guanidine CAS Name: 2-[(4S)-4-amino-5-hydroxy-5-(1-methyl-2-imidazolyl)pentyl]-1-(4-methylphenyl)sulfonylguanidine IUPAC Name: 2-[(4S)-4-amino-5-hydroxy-5-(1-methylimidazol-2-yl)pentyl]-1-(4-methylphenyl)sulfonylguanidine Traditional Name: 2-[(4S)-4-amino-5-hydroxy-5-(1-methylimidazol-2-yl)pentyl]-1-tosyl-guanidine Formula: C17H26N6O3S MolecularWeight: 394.49174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCCC(C(C2=NC=CN2C)O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCC[C@@H](C(C2=NC=CN2C)O)N)N

InChI

InChI=1S/C17H26N6O3S/c1-12-5-7-13(8-6-12)27(25,26)22-17(19)21-9-3-4-14(18)15(24)16-20-10-11-23(16)2/h5-8,10-11,14-15,24H,3-4,9,18H2,1-2H3,(H3,19,21,22)/t14-,15?/m0/s1