1-(3-isocyanatopropylsulfanyl)-2,3-dimethyl-benzene

Systemtic Name: 1-(3-isocyanatopropylsulfanyl)-2,3-dimethyl-benzene Openeye Name: 1-(3-isocyanatopropylsulfanyl)-2,3-dimethyl-benzene CAS Name: 1-(3-isocyanatopropylthio)-2,3-dimethylbenzene IUPAC Name: 1-(3-isocyanatopropylsulfanyl)-2,3-dimethylbenzene Traditional Name: 1-(3-isocyanatopropylthio)-2,3-dimethyl-benzene Formula: C12H15NOS MolecularWeight: 221.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)SCCCN=C=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)SCCCN=C=O)C

InChI

InChI=1S/C12H15NOS/c1-10-5-3-6-12(11(10)2)15-8-4-7-13-9-14/h3,5-6H,4,7-8H2,1-2H3