O-propan-2-yl [2-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-propan-2-yl [2-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-isopropyl [2-[(3-amino-3-oxo-propyl)-benzyl-amino]-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-[(3-amino-3-oxopropyl)-(phenylmethyl)amino]-2-oxoethyl]thio]methanethioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl [2-[(3-amino-3-oxopropyl)-benzylamino]-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-[(3-amino-3-keto-propyl)-benzyl-amino]-2-keto-ethyl]thio]methanethioic acid O-isopropyl ester Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)SCC(=O)N(CCC(=O)N)CC1=CC=CC=C1

Isomeric SMILES

CC(C)OC(=S)SCC(=O)N(CCC(=O)N)CC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O3S2/c1-12(2)21-16(22)23-11-15(20)18(9-8-14(17)19)10-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H2,17,19)