N'-(4-aminophenyl)sulfonyl-3-[(5-methyl-2-piperidin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]propanimidamide

Systemtic Name: N'-(4-aminophenyl)sulfonyl-3-[(5-methyl-2-piperidin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]propanimidamide Openeye Name: N'-(4-aminophenyl)sulfonyl-3-[[5-methyl-2-(2-piperidyl)thiazol-4-yl]methylsulfanyl]propanamidine CAS Name: N'-(4-aminophenyl)sulfonyl-3-[[5-methyl-2-(2-piperidinyl)-4-thiazolyl]methylthio]propanimidamide IUPAC Name: N'-(4-aminophenyl)sulfonyl-3-[(5-methyl-2-piperidin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]propanimidamide Traditional Name: 3-[[5-methyl-2-(2-piperidyl)thiazol-4-yl]methylthio]-N'-sulfanilyl-propionamidine Formula: C19H27N5O2S3 MolecularWeight: 453.64498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2CCCCN2)CSCCC(=NS(=O)(=O)C3=CC=C(C=C3)N)N

Isomeric SMILES

CC1=C(N=C(S1)C2CCCCN2)CSCC/C(=N\S(=O)(=O)C3=CC=C(C=C3)N)/N

InChI

InChI=1S/C19H27N5O2S3/c1-13-17(23-19(28-13)16-4-2-3-10-22-16)12-27-11-9-18(21)24-29(25,26)15-7-5-14(20)6-8-15/h5-8,16,22H,2-4,9-12,20H2,1H3,(H2,21,24)