N-(3-azanyl-2,5-dimethyl-phenyl)ethanethioamide; bicyclo[2.2.0]hexa-1(4),2,5-triene

Systemtic Name: N-(3-azanyl-2,5-dimethyl-phenyl)ethanethioamide; bicyclo[2.2.0]hexa-1(4),2,5-triene Openeye Name: N-(3-amino-2,5-dimethyl-phenyl)thioacetamide; bicyclo[2.2.0]hexa-1(4),2,5-triene CAS Name: N-(3-amino-2,5-dimethylphenyl)ethanethioamide; bicyclo[2.2.0]hexa-1(4),2,5-triene IUPAC Name: N-(3-amino-2,5-dimethylphenyl)ethanethioamide; bicyclo[2.2.0]hexa-1(4),2,5-triene Traditional Name: N-(3-amino-2,5-dimethyl-phenyl)thioacetamide; bicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C16H18N2S MolecularWeight: 270.39252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)NC(=S)C)C)N.C1=CC2=C1C=C2

Isomeric SMILES

CC1=CC(=C(C(=C1)NC(=S)C)C)N.C1=CC2=C1C=C2

InChI

InChI=1S/C10H14N2S.C6H4/c1-6-4-9(11)7(2)10(5-6)12-8(3)13;1-2-6-4-3-5(1)6/h4-5H,11H2,1-3H3,(H,12,13);1-4H