3,3-dimethyl-8-prop-1-en-2-yl-4,5-dihydro-2H-1-benzothiepine

Systemtic Name: 3,3-dimethyl-8-prop-1-en-2-yl-4,5-dihydro-2H-1-benzothiepine Openeye Name: 8-isopropenyl-3,3-dimethyl-4,5-dihydro-2H-1-benzothiepine CAS Name: 3,3-dimethyl-8-(1-methylethenyl)-4,5-dihydro-2H-1-benzothiepin IUPAC Name: 3,3-dimethyl-8-prop-1-en-2-yl-4,5-dihydro-2H-1-benzothiepine Traditional Name: 8-isopropenyl-3,3-dimethyl-4,5-dihydro-2H-1-benzothiepin Formula: C15H20S MolecularWeight: 232.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC2=C(CCC(CS2)(C)C)C=C1

Isomeric SMILES

CC(=C)C1=CC2=C(CCC(CS2)(C)C)C=C1

InChI

InChI=1S/C15H20S/c1-11(2)13-6-5-12-7-8-15(3,4)10-16-14(12)9-13/h5-6,9H,1,7-8,10H2,2-4H3