4-azanyl-5-(5-bromanylthiophen-2-yl)carbonyl-2-(prop-2-enylamino)thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-(5-bromanylthiophen-2-yl)carbonyl-2-(prop-2-enylamino)thiophene-3-carbonitrile Openeye Name: 2-(allylamino)-4-amino-5-(5-bromothiophene-2-carbonyl)thiophene-3-carbonitrile CAS Name: 4-amino-5-[(5-bromo-2-thiophenyl)-oxomethyl]-2-(prop-2-enylamino)-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(5-bromothiophene-2-carbonyl)-2-(prop-2-enylamino)thiophene-3-carbonitrile Traditional Name: 2-(allylamino)-4-amino-5-(5-bromothiophene-2-carbonyl)thiophene-3-carbonitrile Formula: C13H10BrN3OS2 MolecularWeight: 368.272

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C(C(=C(S1)C(=O)C2=CC=C(S2)Br)N)C#N

Isomeric SMILES

C=CCNC1=C(C(=C(S1)C(=O)C2=CC=C(S2)Br)N)C#N

InChI

InChI=1S/C13H10BrN3OS2/c1-2-5-17-13-7(6-15)10(16)12(20-13)11(18)8-3-4-9(14)19-8/h2-4,17H,1,5,16H2