6-methyl-2-(10-phenyldecylsulfanyl)-3,1-benzoxazin-4-one

Systemtic Name: 6-methyl-2-(10-phenyldecylsulfanyl)-3,1-benzoxazin-4-one Openeye Name: 6-methyl-2-(10-phenyldecylsulfanyl)-3,1-benzoxazin-4-one CAS Name: 6-methyl-2-(10-phenyldecylthio)-3,1-benzoxazin-4-one IUPAC Name: 6-methyl-2-(10-phenyldecylsulfanyl)-3,1-benzoxazin-4-one Traditional Name: 6-methyl-2-(10-phenyldecylthio)-3,1-benzoxazin-4-one Formula: C25H31NO2S MolecularWeight: 409.58414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(OC2=O)SCCCCCCCCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(OC2=O)SCCCCCCCCCCC3=CC=CC=C3

InChI

InChI=1S/C25H31NO2S/c1-20-16-17-23-22(19-20)24(27)28-25(26-23)29-18-12-7-5-3-2-4-6-9-13-21-14-10-8-11-15-21/h8,10-11,14-17,19H,2-7,9,12-13,18H2,1H3