5-chloranyl-4-[(phenylmethyl)-propan-2-yl-amino]-1,2-dithiol-3-one

Systemtic Name: 5-chloranyl-4-[(phenylmethyl)-propan-2-yl-amino]-1,2-dithiol-3-one Openeye Name: 4-[benzyl(isopropyl)amino]-5-chloro-dithiol-3-one CAS Name: 5-chloro-4-[(phenylmethyl)-propan-2-ylamino]-3-dithiolone IUPAC Name: 4-[benzyl(propan-2-yl)amino]-5-chlorodithiol-3-one Traditional Name: 4-[benzyl(isopropyl)amino]-5-chloro-dithiol-3-one Formula: C13H14ClNOS2 MolecularWeight: 299.83936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=C(SSC2=O)Cl

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=C(SSC2=O)Cl

InChI

InChI=1S/C13H14ClNOS2/c1-9(2)15(8-10-6-4-3-5-7-10)11-12(14)17-18-13(11)16/h3-7,9H,8H2,1-2H3