(3-chloranyl-4-hexadecoxy-phenyl)-morpholin-4-yl-methanethione

Systemtic Name: (3-chloranyl-4-hexadecoxy-phenyl)-morpholin-4-yl-methanethione Openeye Name: (3-chloro-4-hexadecoxy-phenyl)-morpholino-methanethione CAS Name: (3-chloro-4-hexadecoxyphenyl)-(4-morpholinyl)methanethione IUPAC Name: (3-chloro-4-hexadecoxyphenyl)-morpholin-4-ylmethanethione Traditional Name: (4-cetyloxy-3-chloro-phenyl)-morpholino-methanethione Formula: C27H44ClNO2S MolecularWeight: 482.16176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=S)N2CCOCC2)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=S)N2CCOCC2)Cl

InChI

InChI=1S/C27H44ClNO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-31-26-17-16-24(23-25(26)28)27(32)29-18-21-30-22-19-29/h16-17,23H,2-15,18-22H2,1H3