ethyl N-[(E)-[(2Z)-4-chloranyl-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]carbamate

Systemtic Name: ethyl N-[(E)-[(2Z)-4-chloranyl-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]carbamate Openeye Name: ethyl N-[(E)-[(2Z)-3-allyl-4-chloro-2-(2-thienylsulfonylimino)thiazol-5-yl]methyleneamino]carbamate CAS Name: N-[(E)-[(2Z)-4-chloro-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-5-thiazolyl]methylideneamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-[(2Z)-4-chloro-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]carbamate Traditional Name: N-[(E)-[(2Z)-3-allyl-4-chloro-2-(2-thienylsulfonylimino)-4-thiazolin-5-yl]methyleneamino]carbamic acid ethyl ester Formula: C14H15ClN4O4S3 MolecularWeight: 434.9413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN=CC1=C(N(C(=NS(=O)(=O)C2=CC=CS2)S1)CC=C)Cl

Isomeric SMILES

CCOC(=O)N/N=C/C1=C(N(/C(=N/S(=O)(=O)C2=CC=CS2)/S1)CC=C)Cl

InChI

InChI=1S/C14H15ClN4O4S3/c1-3-7-19-12(15)10(9-16-17-14(20)23-4-2)25-13(19)18-26(21,22)11-6-5-8-24-11/h3,5-6,8-9H,1,4,7H2,2H3,(H,17,20)/b16-9+,18-13-