1-[(E)-[1,3-bis(oxidanylidene)-4H-naphthalen-2-ylidene]methyl]-3-octadecyl-thiourea

Systemtic Name: 1-[(E)-[1,3-bis(oxidanylidene)-4H-naphthalen-2-ylidene]methyl]-3-octadecyl-thiourea Openeye Name: 1-[(E)-(1,3-dioxotetralin-2-ylidene)methyl]-3-octadecyl-thiourea CAS Name: 1-[(E)-(1,3-dioxo-4H-naphthalen-2-ylidene)methyl]-3-octadecylthiourea IUPAC Name: 1-[(E)-(1,3-dioxo-4H-naphthalen-2-ylidene)methyl]-3-octadecylthiourea Traditional Name: 1-[(E)-(1,3-diketotetralin-2-ylidene)methyl]-3-stearyl-thiourea Formula: C30H46N2O2S MolecularWeight: 498.76344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=S)NC=C1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=S)N/C=C/1\C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C30H46N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-31-30(35)32-24-27-28(33)23-25-20-17-18-21-26(25)29(27)34/h17-18,20-21,24H,2-16,19,22-23H2,1H3,(H2,31,32,35)/b27-24+