3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 1,3-thiazolidine-4-carbonitrile

Systemtic Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 1,3-thiazolidine-4-carbonitrile Openeye Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; thiazolidine-4-carbonitrile CAS Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 4-thiazolidinecarbonitrile IUPAC Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 1,3-thiazolidine-4-carbonitrile Traditional Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; thiazolidine-4-carbonitrile Formula: C14H18N2S MolecularWeight: 246.37112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C1C=C2.C1C(NCS1)C#N

Isomeric SMILES

CCCCC1=CC2=C1C=C2.C1C(NCS1)C#N

InChI

InChI=1S/C10H12.C4H6N2S/c1-2-3-4-8-7-9-5-6-10(8)9;5-1-4-2-7-3-6-4/h5-7H,2-4H2,1H3;4,6H,2-3H2