dodecyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioate

Systemtic Name: dodecyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioate Openeye Name: dodecyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioate CAS Name: 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioic acid dodecyl ester IUPAC Name: dodecyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioate Traditional Name: 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidothioic acid lauryl ester Formula: C27H38N2S MolecularWeight: 422.66902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=N)N1CC2=CC=CC=C2C3=CC=CC=C3C1

Isomeric SMILES

CCCCCCCCCCCCSC(=N)N1CC2=CC=CC=C2C3=CC=CC=C3C1

InChI

InChI=1S/C27H38N2S/c1-2-3-4-5-6-7-8-9-10-15-20-30-27(28)29-21-23-16-11-13-18-25(23)26-19-14-12-17-24(26)22-29/h11-14,16-19,28H,2-10,15,20-22H2,1H3