1-[4-[(4-chlorophenyl)amino]pyridin-3-yl]sulfonyl-3-cyano-2-propan-2-yl-guanidine

Systemtic Name: 1-[4-[(4-chlorophenyl)amino]pyridin-3-yl]sulfonyl-3-cyano-2-propan-2-yl-guanidine Openeye Name: 1-[[4-(4-chloroanilino)-3-pyridyl]sulfonyl]-3-cyano-2-isopropyl-guanidine CAS Name: 1-[[4-(4-chloroanilino)-3-pyridinyl]sulfonyl]-3-cyano-2-propan-2-ylguanidine IUPAC Name: 1-[4-(4-chloroanilino)pyridin-3-yl]sulfonyl-3-cyano-2-propan-2-ylguanidine Traditional Name: 1-[[4-(4-chloroanilino)-3-pyridyl]sulfonyl]-3-cyano-2-isopropyl-guanidine Formula: C16H17ClN6O2S MolecularWeight: 392.86318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(NC#N)NS(=O)(=O)C1=C(C=CN=C1)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)N=C(NC#N)NS(=O)(=O)C1=C(C=CN=C1)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN6O2S/c1-11(2)21-16(20-10-18)23-26(24,25)15-9-19-8-7-14(15)22-13-5-3-12(17)4-6-13/h3-9,11H,1-2H3,(H,19,22)(H2,20,21,23)