methyl N-[4-(cycloheptylamino)pyridin-3-yl]sulfonylcarbamodithioate

Systemtic Name: methyl N-[4-(cycloheptylamino)pyridin-3-yl]sulfonylcarbamodithioate Openeye Name: methyl N-[[4-(cycloheptylamino)-3-pyridyl]sulfonyl]carbamodithioate CAS Name: N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]carbamodithioic acid methyl ester IUPAC Name: methyl N-[4-(cycloheptylamino)pyridin-3-yl]sulfonylcarbamodithioate Traditional Name: N-[[4-(cycloheptylamino)-3-pyridyl]sulfonyl]carbamodithioic acid methyl ester Formula: C14H21N3O2S3 MolecularWeight: 359.53044

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)NS(=O)(=O)C1=C(C=CN=C1)NC2CCCCCC2

Isomeric SMILES

CSC(=S)NS(=O)(=O)C1=C(C=CN=C1)NC2CCCCCC2

InChI

InChI=1S/C14H21N3O2S3/c1-21-14(20)17-22(18,19)13-10-15-9-8-12(13)16-11-6-4-2-3-5-7-11/h8-11H,2-7H2,1H3,(H,15,16)(H,17,20)