N-[(E)-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methylideneamino]-3-methyl-2-(2-thiophen-2-ylethanoylamino)butanamide

Systemtic Name: N-[(E)-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methylideneamino]-3-methyl-2-(2-thiophen-2-ylethanoylamino)butanamide Openeye Name: N-[(E)-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyleneamino]-3-methyl-2-[[2-(2-thienyl)acetyl]amino]butanamide CAS Name: N-[(E)-(1,3-dimethyl-2-oxo-5-benzimidazolyl)methylideneamino]-3-methyl-2-[(1-oxo-2-thiophen-2-ylethyl)amino]butanamide IUPAC Name: N-[(E)-(1,3-dimethyl-2-oxobenzimidazol-5-yl)methylideneamino]-3-methyl-2-[(2-thiophen-2-ylacetyl)amino]butanamide Traditional Name: N-[(E)-(2-keto-1,3-dimethyl-benzimidazol-5-yl)methyleneamino]-3-methyl-2-[[2-(2-thienyl)acetyl]amino]butyramide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NN=CC1=CC2=C(C=C1)N(C(=O)N2C)C)NC(=O)CC3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)N/N=C/C1=CC2=C(C=C1)N(C(=O)N2C)C)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C21H25N5O3S/c1-13(2)19(23-18(27)11-15-6-5-9-30-15)20(28)24-22-12-14-7-8-16-17(10-14)26(4)21(29)25(16)3/h5-10,12-13,19H,11H2,1-4H3,(H,23,27)(H,24,28)/b22-12+