[2-[(2R,4S)-2-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-[(2R,4S)-2-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-[(2R,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-[(2R,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl] ester IUPAC Name: [2-[(2R,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-[(2R,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-keto-ethyl] ester Formula: C23H29N3OS2 MolecularWeight: 427.62586

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)N1C(CC(C2=CC=CC=C21)NC3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)N1[C@@H](C[C@@H](C2=CC=CC=C21)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H29N3OS2/c1-4-25(5-2)23(28)29-16-22(27)26-17(3)15-20(19-13-9-10-14-21(19)26)24-18-11-7-6-8-12-18/h6-14,17,20,24H,4-5,15-16H2,1-3H3/t17-,20+/m1/s1