2-[[[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[[[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile Openeye Name: 2-[[[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]amino]methylene]propanedinitrile CAS Name: 2-[[[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]amino]methylidene]propanedinitrile IUPAC Name: 2-[[[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]amino]methylidene]propanedinitrile Traditional Name: 2-[[[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]amino]methylene]malononitrile Formula: C16H15N5S MolecularWeight: 309.3888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC=C(C#N)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC=C(C#N)C#N

InChI

InChI=1S/C16H15N5S/c1-4-5-21-11(2)6-14(12(21)3)15-10-22-16(20-15)19-9-13(7-17)8-18/h4,6,9-10H,1,5H2,2-3H3,(H,19,20)