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1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-hexadecyl-thiourea

1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-hexadecyl-thiourea

Systemtic Name:1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-hexadecyl-thiourea
Openeye Name:1-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-3-hexadecyl-thiourea
CAS Name:1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-hexadecylthiourea
IUPAC Name:1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-hexadecylthiourea
Traditional Name:1-cetyl-3-[(E)-veratrylideneamino]thiourea
Formula: C26H45N3O2S
MolecularWeight: 463.7194
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NN=CC1=CC(=C(C=C1)OC)OC


Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)N/N=C/C1=CC(=C(C=C1)OC)OC


InChI

InChI=1S/C26H45N3O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-26(32)29-28-22-23-18-19-24(30-2)25(21-23)31-3/h18-19,21-22H,4-17,20H2,1-3H3,(H2,27,29,32)/b28-22+


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