2-(1,3-benzothiazol-2-ylsulfanyl)-3-(3-prop-2-ynoxyphenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(3-prop-2-ynoxyphenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(3-prop-2-ynoxyphenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(3-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(3-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(3-propargyloxyphenyl)acrylonitrile Formula: C19H12N2OS2 MolecularWeight: 348.44138

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

C#CCOC1=CC=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H12N2OS2/c1-2-10-22-15-7-5-6-14(11-15)12-16(13-20)23-19-21-17-8-3-4-9-18(17)24-19/h1,3-9,11-12H,10H2