2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-propan-2-yloxynaphthalen-1-yl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-propan-2-yloxynaphthalen-1-yl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-isopropoxy-1-naphthyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2-propan-2-yloxy-1-naphthalenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-propan-2-yloxynaphthalen-1-yl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(2-isopropoxy-1-naphthyl)acrylonitrile Formula: C23H18N2OS2 MolecularWeight: 402.53182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C2=CC=CC=C2C=C1)C=C(C#N)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)OC1=C(C2=CC=CC=C2C=C1)C=C(C#N)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H18N2OS2/c1-15(2)26-21-12-11-16-7-3-4-8-18(16)19(21)13-17(14-24)27-23-25-20-9-5-6-10-22(20)28-23/h3-13,15H,1-2H3