1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfino-amino]pyrazole; propylbenzene

Systemtic Name: 1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfino-amino]pyrazole; propylbenzene Openeye Name: 1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfino-amino]pyrazole; propylbenzene CAS Name: 1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfinoamino]pyrazole; propylbenzene IUPAC Name: 1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfinoamino]pyrazole; propylbenzene Traditional Name: 1-ethyl-5-[(4-propylphenyl)sulfonyl-sulfino-amino]pyrazole; propylbenzene Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1.CCCC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=NN2CC)S(=O)O

Isomeric SMILES

CCCC1=CC=CC=C1.CCCC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=NN2CC)S(=O)O

InChI

InChI=1S/C14H19N3O4S2.C9H12/c1-3-5-12-6-8-13(9-7-12)23(20,21)17(22(18)19)14-10-11-15-16(14)4-2;1-2-6-9-7-4-3-5-8-9/h6-11H,3-5H2,1-2H3,(H,18,19);3-5,7-8H,2,6H2,1H3